Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Tetrabuthylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.75 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.52 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | RAD52 | P43351 | 1/20 | 0.50 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.50 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL6545372 | 0.94 | SLC22A1 (0.75) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL7536172 | 0.94 | SLC22A1 (0.75) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL27575970 | 0.94 | SLC22A1 (0.75) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL5841582 | 0.90 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL9117 | 0.90 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL1473709 | 0.90 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL28454683 | 0.90 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL29119812 | 0.90 | SLC22A1 (0.92) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Hydrochloric Acid SCHEMBL10380753 | 0.88 | SLC22A1 (0.67) | SLC22A1SLC22A2ALDH1A1TSHRTP53 | |
| Tetrabuthylammonium SCHEMBL28731415 | 0.88 | SLC22A1 (0.75) | SLC22A1SLC22A2ALDH1A1TSHRTP53 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110590732-B | Preparation method of piper nigrum rings | 河北海力香料股份有限公司 | 2021-05-25 | — | — | CN | disclosed |
| CN-110590732-A | Preparation method of piper nigrum rings | 河北海力香料股份有限公司 | 2019-12-20 | — | — | CN | disclosed |